NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *1 M 4.6000 8.4045 120.7137 54.3676 33.9814 176.7200 2 D 4.8445 6.0500 116.0219 52.1052 44.2600 173.3799 3 V 5.1088 8.8888 118.1031 58.8050 36.0337 174.6898 4 A 4.6303 9.1624 124.4291 50.6494 22.6941 175.6004 5 G 3.8339 8.2072 108.3315 44.3553 0.0000 172.2421 6 L 4.4962 7.5818 119.0491 54.4007 46.2570 173.5641 7 T 5.2996 8.3898 119.9831 59.5151 71.0863 171.9055 8 D 4.4397 7.9802 118.7370 54.0296 43.7154 176.8187 9 C 4.3730 7.8684 122.1421 60.8552 28.8995 173.3320 10 G 4.0143 8.9762 104.6709 44.3303 0.0000 172.7269 11 L 4.4843 7.5765 117.8943 54.7890 41.9908 176.2840 12 I 4.2767 6.9407 116.4278 62.1317 40.0575 175.6503 13 R 3.9172 7.9286 122.1517 57.5616 30.6613 178.0633 14 K 4.1684 8.6915 124.0908 56.7183 32.4093 174.4805 15 S 4.6737 7.5405 112.2640 58.0697 65.3708 172.8721 16 N 4.4599 8.3503 118.9364 54.2207 39.7026 174.1700 17 Q 4.5989 8.5898 124.3569 55.9310 30.1665 175.3806 18 D 5.2915 8.8683 120.4434 54.0698 42.9431 175.2316 19 A 4.7688 8.7057 120.8478 51.4674 23.1128 175.1113 20 F 5.3085 8.0750 113.2994 56.8445 41.1867 172.5977 21 Y 4.8540 8.8785 117.1869 56.8693 42.5593 172.7840 22 I 4.0119 7.5771 126.5101 59.2166 40.1613 176.0990 23 D 3.8780 6.5476 126.8699 52.4529 39.3994 176.2866 24 E 3.7874 8.0636 125.2628 59.4401 29.7201 179.2392 25 K 3.9944 7.8036 118.4960 57.4217 31.9541 179.0146 26 H 4.6804 8.0820 115.8204 55.1624 29.9101 175.4223 27 Q 3.4328 8.3256 119.6586 57.6500 26.4373 175.3727 28 R 4.6855 8.4249 120.2657 58.4881 30.9899 178.7125 29 F 6.2965 7.2954 110.8635 55.2646 41.9453 173.7065 30 F 4.9168 9.0893 116.9225 56.1544 43.6369 173.6530 31 I 5.4097 8.8920 121.2950 60.2649 42.1286 174.9042 32 V 5.1080 8.3760 116.2909 60.5257 36.7745 173.1309 33 A 5.4664 9.4241 126.9597 49.3223 22.6945 174.2254 34 D 4.9151 8.5311 123.4547 52.3827 42.1322 176.1042 35 G 4.4858 8.8748 114.4741 45.7437 0.0000 171.7114 36 M 5.0691 9.1938 116.9321 53.8080 35.4635 172.4222 37 G 3.7192 8.9490 105.3959 43.6009 0.0000 173.9687 38 G 4.0422 8.5173 114.5975 45.7490 0.0000 172.1674 39 H 3.8951 9.1593 113.1967 57.3611 25.9872 174.8997 40 A 4.4154 7.4643 114.1468 52.0951 16.7764 180.2926 41 G 3.7096 8.3490 108.9250 49.1859 0.0000 176.7364 42 G 3.6210 8.0289 107.7740 47.6265 0.0000 175.5486 43 E 3.9527 8.1289 120.7766 59.1550 29.5269 178.9440 44 E 3.9036 7.9100 118.7987 59.2065 29.5844 178.4202 45 A 3.9538 8.2133 121.1300 55.2297 18.4479 179.5734 46 S 4.2778 8.3767 116.0286 61.5911 63.0015 177.4226 47 R 3.8935 8.0784 124.3271 61.1111 29.0725 180.3340 48 L 4.1315 8.2416 120.2461 57.5373 41.5444 179.5757 49 A 3.8804 8.1646 120.6490 55.1495 18.3161 179.8463 50 V 3.5230 7.8741 116.6140 66.3171 31.5885 177.9199 51 D 4.2458 8.5328 118.8899 57.7783 40.6840 178.6597 52 H 4.1206 8.5658 116.9432 58.7448 28.6291 178.0577 53 I 3.6676 7.9837 121.8763 64.2157 36.9785 178.1502 54 R 3.7694 8.0371 119.6272 59.7095 29.3725 178.2004 55 Q 3.9032 8.2852 119.3776 59.4010 28.9638 177.6609 56 Y 3.9757 8.1196 120.4914 60.5678 38.6337 178.0688 57 L 3.8340 8.0339 120.1940 57.6113 41.5001 179.0821 58 E 4.0368 7.9006 116.8649 58.7072 29.3725 178.6247 59 T 4.2180 7.0994 114.3370 64.7027 69.3142 175.2542 60 H 4.6986 7.5721 118.3087 56.0208 29.6120 176.8444 61 L 3.8933 7.7359 123.8579 58.1599 41.0758 183.3708 62 E 4.0369 8.3629 116.8758 59.4820 29.8741 180.9209 63 D 4.5698 8.3165 119.6695 55.9741 40.1069 179.4209 64 L 4.6613 8.3892 117.7445 53.4999 42.2474 180.4029 65 Q 4.1961 7.9575 118.8649 59.7053 28.4748 177.4522 66 H 4.4348 7.9295 113.3591 57.5491 29.3385 175.1161 67 D 4.5870 8.0516 120.3463 50.3259 41.2486 173.2872 68 P 3.8416 0.0000 0.0000 65.2275 31.2086 178.3028 69 V 3.3070 7.1072 117.4684 66.0792 31.2459 177.7612 70 T 3.7740 7.8777 114.3917 66.9708 68.2826 175.4415 71 L 3.9189 7.5315 121.0694 58.7981 41.8315 178.8626 72 L 4.0821 8.5514 118.3269 58.0163 41.9516 179.4870 73 R 3.7860 8.1887 118.6806 59.7659 29.9260 178.4771 74 Q 3.8248 8.7323 117.5965 58.6915 28.8130 178.4466 75 A 3.3203 8.1399 121.9601 55.2069 18.4783 179.4220 76 F 3.8152 8.7106 116.4082 60.9574 39.0379 178.0845 77 L 4.0323 7.8995 117.6205 57.6492 41.4546 179.2037 78 A 3.9403 7.8150 120.5581 55.0901 18.1264 179.6864 79 A 3.7922 7.7175 118.6567 55.3504 18.6174 179.0638 80 N 4.1391 8.4804 116.0588 57.3059 38.7746 176.4607 81 H 4.0854 8.8363 119.3341 59.1298 29.8088 176.7799 82 A 3.8881 7.5357 121.0047 55.3900 18.4274 179.4471 83 I 3.7151 7.7560 117.8959 64.6759 37.3377 178.8161 84 V 4.3436 7.6491 120.2357 65.6096 30.9576 177.9126 85 E 3.9599 8.1402 117.8598 59.3604 29.5466 178.9740 86 Q 4.1227 8.1209 118.1584 58.6434 28.7363 178.6163 87 Q 3.9795 7.9870 118.8518 59.1256 28.6758 178.8845 88 R 4.0356 7.6731 116.7709 58.4596 30.1143 177.6674 89 Q 4.2748 7.8272 117.1482 55.8101 28.7402 175.0058 90 N 4.2079 8.5306 131.6065 55.1218 39.4454 176.1380 *91 S 4.2354 8.5251 122.5933 60.1868 62.7473 172.4064 92 A 4.1820 7.8770 120.0203 54.6006 18.5203 178.3160 93 R 4.6143 7.6353 114.8558 55.7936 30.7464 177.9661 94 A 4.0243 8.2248 124.0291 54.9227 18.4144 178.8058 95 D 4.8512 7.9143 113.7094 53.3386 39.7829 176.5394 96 M 4.4231 7.9200 117.0729 56.2168 31.9626 175.0718 97 G 4.1391 8.4760 106.1232 46.6898 0.0000 171.6280 98 T 5.1985 8.5486 113.4157 61.4747 71.6669 172.1177 99 T 4.9400 8.2711 115.2523 60.3279 72.4615 172.6826 100 A 5.1031 8.4970 120.1417 51.2768 23.0730 175.9442 101 V 5.1860 8.8320 114.2230 59.7981 36.0742 175.0239 102 V 5.5023 9.2089 123.3400 60.7226 35.8193 173.6299 103 I 5.3252 8.7489 125.6918 59.4682 40.8851 174.0316 104 L 5.3990 9.4158 131.3512 53.9459 44.4082 175.8810 *105 L 4.6737 9.2904 129.7567 54.4133 41.9874 173.4182 106 D 4.7553 8.9985 125.0979 54.1899 41.8382 177.9821 *107 E 3.9290 9.3218 119.4195 59.9409 29.7187 180.6657 *108 K 4.3139 8.2777 120.5185 59.2264 32.1760 179.9757 109 G 4.1469 7.7976 108.3138 47.1362 0.0000 177.0736 *110 D 4.7721 8.4345 129.3542 54.6631 42.2213 179.8541 111 R 4.9094 7.9463 117.0125 55.0173 32.9335 178.5663 112 A 4.9668 9.1205 124.2016 49.7064 22.0164 175.1783 113 W 4.6975 9.3112 123.8430 56.2532 31.0423 175.4275 114 C 5.4260 9.3846 122.6020 58.1143 30.2412 172.8225 115 A 5.8548 8.8050 125.9364 49.7535 21.8520 174.5119 116 H 5.2835 8.0717 112.5925 55.2630 31.8150 173.4343 117 V 4.3111 9.1584 120.4883 64.1617 34.5647 172.5267 118 G 4.0218 8.4750 116.0456 44.5275 0.0000 173.9724 119 D 5.1122 8.6691 124.6155 53.1245 40.0922 175.5061 120 S 4.7157 7.9135 115.9427 58.2681 64.8338 173.8181 121 R 4.8188 8.2646 122.6958 53.9129 33.4504 175.0267 122 I 5.1094 7.7280 119.5354 59.9931 40.8770 174.4792 123 Y 5.2887 9.1833 126.2731 56.8000 42.0667 175.5196 124 R 5.0704 9.5657 121.5801 55.0076 33.3358 174.9934 125 W 5.2137 8.9778 135.0000 54.8079 32.7245 175.0435 126 R 4.1134 8.4143 129.3812 56.3413 33.0388 174.9202 127 K 3.4159 8.5451 125.8797 56.9982 28.8786 170.7324 128 D 4.3836 6.4245 126.1279 54.7164 38.9116 176.3229 129 Q 4.2457 6.5990 118.3360 54.8162 32.0979 175.6022 *130 L 5.0068 8.6851 128.9867 53.3902 42.5985 173.2125 131 Q 4.7360 9.2215 124.0277 52.9133 32.2963 171.4304 132 Q 4.0233 8.8487 125.5466 55.0071 29.2654 175.4059 133 I 4.0703 8.5857 128.8384 64.0326 37.8809 176.9954 134 T 4.0897 7.5155 111.0930 60.5488 70.0541 173.7462 135 S 4.6937 8.0147 118.6619 56.8943 63.9977 173.7676 136 D 4.4090 8.4180 124.1942 55.0093 41.1106 178.2341 137 H 4.6842 8.7826 123.5182 54.6023 27.3969 174.2115 138 T 4.7919 7.2196 112.6660 58.3608 73.6353 174.9350 139 W 4.3191 7.8845 122.8238 60.8584 28.4339 179.6992 140 I 3.8729 8.1401 119.2821 64.9808 34.6939 179.8746 141 A 4.1264 7.9331 120.8720 55.4813 18.5042 179.5807 142 Q 4.0728 8.2140 114.6475 58.6213 28.7285 178.2243 143 A 4.3010 7.8710 121.6812 54.5466 19.1197 178.6186 144 V 3.7341 7.2524 123.5910 63.8489 29.8065 175.3280 145 Q 5.3427 8.5077 135.0000 57.5778 30.5603 175.4490 *150 T 4.4381 7.7260 114.0468 60.7969 70.5602 178.4299 151 I 4.6888 7.2703 117.7114 57.5936 39.5910 176.4970 152 E 4.2664 8.7529 124.9634 55.9035 30.1988 178.3279 153 Q 4.1251 8.6289 114.0156 56.3117 27.8291 176.8841 154 A 4.5200 7.9578 125.7285 52.3888 18.0380 178.7889 155 R 4.6036 7.7656 125.4561 54.8465 29.2524 176.9316 156 Q 4.3998 7.7093 118.3273 56.2075 29.9926 174.8523 157 H 4.2710 8.1062 116.1103 56.6995 30.6728 172.9739 158 P 4.4074 0.0000 0.0000 65.7489 29.9270 178.5472 159 W 4.4898 7.9139 116.7684 56.9072 29.0836 178.4994 160 R 4.2986 8.0529 122.0359 59.3383 29.6720 176.9960 161 H 4.5818 7.5933 112.1058 56.8311 29.7127 175.5813 162 V 3.6192 8.0598 118.8819 63.2589 31.4332 175.3102 163 L 4.3231 8.5506 127.1817 54.8714 42.0910 177.0562 164 S 4.0665 8.6112 115.0217 57.9403 63.7954 174.0652 165 Q 4.5600 6.9476 118.7186 54.7740 32.5470 173.5179 166 C 4.9136 7.9156 113.0679 57.5577 31.5399 173.7268 167 L 4.0506 8.1127 123.3565 56.0311 41.6167 177.7091 168 G 4.1841 8.9617 113.0533 45.6815 0.0000 173.4555 169 R 4.6288 8.0173 118.1161 53.8645 33.3994 175.9719 170 E 4.2229 8.9977 120.1142 57.6455 29.8987 176.8064 171 D 4.6220 7.8235 118.0553 53.0542 40.2231 175.5469 172 L 3.7930 7.2616 122.4202 55.3650 41.3996 176.7034 173 S 4.6235 8.1637 123.4090 57.5865 63.4557 174.1952 174 Q 4.2793 7.4815 116.8400 56.8973 30.1824 172.7393 175 I 4.1689 8.0214 127.5132 59.0028 38.5090 174.5049 176 D 4.4608 8.5719 127.0209 54.4861 41.5521 175.2896 177 I 5.1504 8.0153 124.7952 59.4126 39.8489 175.4718 178 Q 4.8517 9.1839 123.1422 54.6994 31.9976 171.9670 179 P 4.6436 0.0000 0.0000 62.1847 32.7797 175.1829 180 I 4.6040 8.2163 113.8942 59.4178 41.2944 173.7070 181 D 4.9228 8.7165 126.1198 54.2305 42.1865 176.3503 *182 L 4.6208 10.1191 124.6798 53.3149 43.1248 174.8840 183 E 4.4182 9.0470 125.4538 53.8230 29.8043 173.5483 184 P 4.1131 0.0000 0.0000 62.0404 32.0350 174.9683 185 G 4.2955 8.9075 115.8434 46.1719 0.0000 174.3133 186 D 4.8438 8.1561 121.5763 53.8313 40.9184 176.1350 *187 R 5.0124 9.0503 119.3100 55.1070 33.5640 175.5555 188 L 5.2686 9.2113 119.8049 53.2205 45.1272 175.4562 189 L 5.1809 8.7594 124.3805 53.2195 45.8462 175.1653 190 L 5.3383 8.7789 124.7819 53.2628 45.0536 175.2741 191 C 5.8707 9.4372 118.2934 55.5578 33.9980 172.7591 192 S 4.9707 8.6243 112.5102 55.2311 65.4632 174.8329 193 D 4.5651 9.0031 121.0833 56.9014 38.4425 179.2473 194 G 3.9752 8.1499 107.2452 47.5599 0.0000 174.5791 195 L 4.1113 8.4963 123.5840 57.5783 41.9450 178.8330 196 T 4.1514 7.7710 112.6506 64.1037 68.7730 175.5085 197 E 4.2020 8.3791 120.3064 58.0348 29.6005 177.1055 198 E 4.4961 8.1186 116.8690 56.6657 31.1660 176.0708 199 L 4.7823 8.0219 118.5724 52.8977 44.2112 176.2650 200 T 4.2863 8.1325 112.9137 61.1240 71.4111 175.5098 201 D 4.4716 8.7122 121.6758 58.0091 40.7382 178.6517 202 D 4.3338 8.0730 119.0946 57.0002 41.0277 178.2772 203 V 3.4852 7.6246 117.8176 66.3905 31.5927 178.2788 204 I 3.7133 8.1752 119.4847 64.5443 36.7271 178.1739 205 S 4.0686 8.0230 112.7792 61.5626 62.4639 175.8429 206 I 3.6915 7.6723 122.1855 64.9246 36.9810 178.0337 207 Y 4.2311 7.6258 119.1805 61.6617 37.4459 179.4908 208 L 3.8499 7.5612 122.6981 58.8150 40.9672 182.3761 209 S 3.0835 7.0581 112.2365 59.5788 62.9269 174.4066 210 E 3.7409 6.9683 122.5938 56.0586 29.6870 174.6811 211 P 4.2665 0.0000 0.0000 65.4485 31.8318 176.7386 212 N 4.6243 7.9046 116.9242 52.5991 39.9906 175.9012 213 V 3.7348 8.4699 124.1826 65.2475 31.6244 179.1531 214 Q 4.0753 8.2205 122.3924 60.3346 27.9520 181.6926 215 K 4.1765 9.0108 124.6707 59.7379 31.7372 182.7878 216 A 4.0612 8.4225 122.3974 54.9148 18.3578 179.2111 217 A 3.8369 8.1611 119.3072 55.5453 18.4001 179.8001 218 A 3.8277 7.7225 118.5861 55.1634 18.4632 179.5629 219 A 3.7291 8.1402 119.7092 55.2116 18.3110 179.8622 220 L 3.5989 8.3896 117.9335 57.9126 41.6380 180.0382 221 V 3.5675 7.7641 120.6096 66.3979 31.4438 178.3860 222 D 4.2455 8.4826 120.9903 58.3547 39.7220 179.9687 223 A 4.0093 7.9727 122.7405 55.0121 18.0360 179.1665 224 A 3.9036 7.7144 117.6387 55.7186 18.7282 179.7718 225 K 4.2321 8.1317 117.9229 59.4069 31.8462 179.8231 226 T 4.0080 7.8848 117.7645 67.2588 68.4324 176.6481 *227 H 4.4946 7.8235 118.9405 56.9708 27.9956 177.7455 228 G 4.6411 6.1759 104.9456 44.1018 0.0000 173.5275 229 G 3.9501 8.0445 107.4766 44.7374 0.0000 175.5363 230 R 3.8335 7.7938 121.2012 58.4160 30.3117 176.2824 231 D 4.9842 7.5707 113.5460 51.6619 44.3710 174.3759 232 N 4.9420 8.7802 118.9812 52.5580 39.2480 174.4785 233 V 4.7163 8.5152 122.0842 60.2446 34.4879 174.7626 234 T 5.1153 8.6415 119.5173 62.0501 72.9277 173.3355 235 V 4.8821 9.0385 117.7968 59.7427 36.8477 174.5812 236 V 4.4820 8.6256 123.2489 61.3495 34.4968 174.3821 237 V 4.7510 9.0796 124.9860 60.2479 33.9004 175.6464 238 I 4.7058 8.7839 125.8047 58.5864 38.6729 170.8560 239 S 4.8346 9.4679 125.7078 56.3433 64.3124 175.0387 240 V 4.1398 8.3409 125.6356 61.4967 32.0721 172.0815 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ *1 M 8.40 4.60 0.00 1.82 1.78 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.13 0.00 2 D 6.05 4.84 0.00 2.31 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 V 8.89 5.11 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.06 0.00 0.00 4 A 9.16 4.63 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 G 8.21 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 7.58 4.50 0.00 1.68 1.36 0.95 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.39 5.30 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 8 D 7.98 4.44 0.00 2.72 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 C 7.87 4.37 0.00 3.03 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 G 8.98 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.58 4.48 0.00 1.60 1.70 0.98 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 12 I 6.94 4.28 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.85 0.90 0.00 0.00 13 R 7.93 3.92 0.00 1.91 1.89 0.00 3.20 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 14 K 8.69 4.17 0.00 1.78 1.72 0.00 1.79 0.00 0.00 1.76 0.00 0.00 2.98 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.36 0.99 7.81 15 S 7.54 4.67 0.00 4.13 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 N 8.35 4.46 0.00 2.67 2.73 0.00 0.00 6.77 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 Q 8.59 4.60 0.00 2.18 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.72 0.00 0.00 0.00 0.00 0.00 2.59 2.37 0.00 18 D 8.87 5.29 0.00 2.86 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 A 8.71 4.77 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 F 8.08 5.31 0.00 3.21 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 8.88 4.85 0.00 3.05 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.58 4.01 1.68 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.91 0.77 0.00 0.00 23 D 6.55 3.88 0.00 1.58 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 E 8.06 3.79 0.00 1.92 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.20 0.00 25 K 7.80 3.99 0.00 1.77 1.69 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.05 7.81 26 H 8.08 4.68 0.00 3.30 3.42 0.00 5.81 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 Q 8.33 3.43 0.00 2.24 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.91 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 28 R 8.42 4.69 0.00 1.50 1.92 0.00 3.23 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.44 0.00 29 F 7.30 6.30 0.00 3.30 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 F 9.09 4.92 0.00 2.95 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 8.89 5.41 2.12 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 1.02 0.00 0.00 32 V 8.38 5.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.08 0.00 0.00 33 A 9.42 5.47 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 D 8.53 4.92 0.00 2.80 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 G 8.87 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 M 9.19 5.07 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.56 0.00 37 G 8.95 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 8.52 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 H 9.16 3.90 0.00 3.25 3.35 0.00 6.05 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 7.46 4.42 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.35 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 G 8.03 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.13 3.95 0.00 2.20 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.60 0.00 44 E 7.91 3.90 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 45 A 8.21 3.95 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 S 8.38 4.28 0.00 4.16 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 R 8.08 3.89 0.00 1.84 1.99 0.00 3.28 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 48 L 8.24 4.13 0.00 1.84 1.64 0.91 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 49 A 8.16 3.88 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 V 7.87 3.52 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.01 0.00 0.00 51 D 8.53 4.25 0.00 2.69 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 H 8.57 4.12 0.00 3.27 3.31 0.00 5.64 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 I 7.98 3.67 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.60 0.86 0.00 0.00 54 R 8.04 3.77 0.00 1.91 2.20 0.00 3.01 0.00 0.00 3.09 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.17 0.00 55 Q 8.29 3.90 0.00 2.21 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.24 0.00 56 Y 8.12 3.98 0.00 3.18 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 L 8.03 3.83 0.00 1.12 1.12 0.55 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 58 E 7.90 4.04 0.00 2.02 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.64 0.00 59 T 7.10 4.22 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 60 H 7.57 4.70 0.00 2.84 3.08 0.00 5.82 0.00 0.00 0.00 0.00 5.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 L 7.74 3.89 0.00 1.52 1.67 0.92 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.36 4.04 0.00 1.98 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.88 0.00 63 D 8.32 4.57 0.00 2.69 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 L 8.39 4.66 0.00 1.47 1.59 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 65 Q 7.96 4.20 0.00 2.21 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.98 0.00 0.00 0.00 0.00 0.00 2.53 2.34 0.00 66 H 7.93 4.43 0.00 3.26 3.50 0.00 5.66 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.05 4.59 0.00 2.59 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 P 0.00 3.84 0.00 0.49 1.30 0.00 3.44 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.54 0.00 69 V 7.11 3.31 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.75 0.00 0.00 70 T 7.88 3.77 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 71 L 7.53 3.92 0.00 1.63 1.71 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 72 L 8.55 4.08 0.00 1.63 1.76 1.03 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 73 R 8.19 3.79 0.00 1.87 2.03 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 74 Q 8.73 3.82 0.00 2.35 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.56 2.60 0.00 75 A 8.14 3.32 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 F 8.71 3.82 0.00 3.17 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 7.90 4.03 0.00 1.75 1.66 0.88 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 78 A 7.82 3.94 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 A 7.72 3.79 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 N 8.48 4.14 0.00 2.87 3.01 0.00 0.00 6.94 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 H 8.84 4.09 0.00 3.25 3.49 0.00 5.86 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 A 7.54 3.89 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.76 3.72 1.83 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.01 0.89 0.00 0.00 84 V 7.65 4.34 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.02 0.00 0.00 85 E 8.14 3.96 0.00 2.35 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 R 7.95 4.91 0.00 1.47 1.79 0.00 3.15 0.00 0.00 3.34 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.17 0.00 112 A 9.12 4.97 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 W 9.31 4.70 0.00 3.53 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 C 9.38 5.43 0.00 2.97 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 A 8.81 5.85 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.07 5.28 0.00 3.37 3.39 0.00 5.43 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 V 9.16 4.31 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.10 0.00 0.00 118 G 8.48 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 D 8.67 5.11 0.00 2.78 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 S 7.91 4.72 0.00 3.86 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 R 8.26 4.82 0.00 1.65 1.39 0.00 3.11 0.00 0.00 3.18 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.37 0.00 122 I 7.73 5.11 1.79 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.82 0.91 0.00 0.00 123 Y 9.18 5.29 0.00 2.86 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 R 9.57 5.07 0.00 1.40 1.75 0.00 3.24 0.00 0.00 3.09 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.40 0.00 125 W 8.98 5.21 0.00 3.37 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.41 4.11 0.00 1.76 1.50 0.00 3.18 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.47 0.00 127 K 8.55 3.42 0.00 1.90 1.63 0.00 2.01 0.00 0.00 1.70 0.00 0.00 2.71 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.28 1.01 7.81 128 D 6.42 4.38 0.00 2.67 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 Q 6.60 4.25 0.00 2.10 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.85 0.00 0.00 0.00 0.00 0.00 2.19 2.15 0.00 *130 L 8.69 5.01 0.00 1.42 1.48 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 9.22 4.74 0.00 1.67 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.93 0.00 0.00 0.00 0.00 0.00 2.17 2.14 0.00 132 Q 8.85 4.02 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 7.01 0.00 0.00 0.00 0.00 0.00 2.14 1.51 0.00 133 I 8.59 4.07 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.91 0.94 0.00 0.00 134 T 7.52 4.09 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 135 S 8.01 4.69 0.00 3.87 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 D 8.42 4.41 0.00 2.65 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 H 8.78 4.68 0.00 3.21 3.07 0.00 5.58 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 T 7.22 4.79 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 139 W 7.88 4.32 0.00 3.61 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 I 8.14 3.87 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.73 0.91 0.00 0.00 141 A 7.93 4.13 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 Q 8.21 4.07 0.00 2.11 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.86 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 143 A 7.87 4.30 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 V 7.25 3.73 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.98 0.00 0.00 145 Q 8.51 5.34 0.00 2.69 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.41 0.00 0.00 0.00 0.00 0.00 2.14 1.64 0.00 *150 T 7.73 4.44 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 151 I 7.27 4.69 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.05 0.91 0.00 0.00 152 E 8.75 4.27 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.26 0.00 153 Q 8.63 4.13 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.29 0.00 0.00 0.00 0.00 0.00 2.28 1.93 0.00 154 A 7.96 4.52 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 R 7.77 4.60 0.00 1.82 1.75 0.00 3.26 0.00 0.00 3.15 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.15 0.00 156 Q 7.71 4.40 0.00 2.02 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.86 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 157 H 8.11 4.27 0.00 3.17 3.32 0.00 5.99 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 P 0.00 4.41 0.00 2.30 2.07 0.00 3.40 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.13 0.00 159 W 7.91 4.49 0.00 3.55 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 R 8.05 4.30 0.00 2.00 2.00 0.00 3.23 0.00 0.00 3.48 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.55 0.00 161 H 7.59 4.58 0.00 3.19 3.35 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 V 8.06 3.62 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 1.03 0.00 0.00 163 L 8.55 4.32 0.00 1.68 1.68 0.99 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.61 4.07 0.00 2.72 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 Q 6.95 4.56 0.00 1.94 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.94 0.00 0.00 0.00 0.00 0.00 2.04 2.00 0.00 166 C 7.92 4.91 0.00 3.13 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 L 8.11 4.05 0.00 1.84 1.63 0.78 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 168 G 8.96 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 R 8.02 4.63 0.00 1.81 1.92 0.00 3.34 0.00 0.00 3.43 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 170 E 9.00 4.22 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 171 D 7.82 4.62 0.00 2.82 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 L 7.26 3.79 0.00 1.78 1.73 0.98 1.02 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0.00 0.00 0.00 0.00 0.00 1.36 0.75 0.83 0.00 0.00 181 D 8.72 4.92 0.00 2.52 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *182 L 10.12 4.62 0.00 1.41 1.45 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 183 E 9.05 4.42 0.00 1.99 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.21 0.00 184 P 0.00 4.11 0.00 2.05 1.96 0.00 3.64 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.15 0.00 185 G 8.91 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 D 8.16 4.84 0.00 3.09 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *187 R 9.05 5.01 0.00 1.51 1.79 0.00 3.20 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.44 0.00 188 L 9.21 5.27 0.00 1.38 1.46 0.86 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 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4.20 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.55 0.00 198 E 8.12 4.50 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.24 0.00 199 L 8.02 4.78 0.00 1.68 1.58 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 200 T 8.13 4.29 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 201 D 8.71 4.47 0.00 2.73 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 D 8.07 4.33 0.00 2.67 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 V 7.62 3.49 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.94 0.00 0.00 204 I 8.18 3.71 1.82 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.43 0.65 0.00 0.00 205 S 8.02 4.07 0.00 4.00 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 I 7.67 3.69 1.55 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.45 0.51 0.00 0.00 207 Y 7.63 4.23 0.00 2.95 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 L 7.56 3.85 0.00 1.76 1.59 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 209 S 7.06 3.08 0.00 4.04 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 E 6.97 3.74 0.00 1.98 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 211 P 0.00 4.27 0.00 2.06 2.10 0.00 3.68 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 212 N 7.90 4.62 0.00 2.73 2.66 0.00 0.00 7.18 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 V 8.47 3.73 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.86 0.00 0.00 214 Q 8.22 4.08 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.93 0.00 0.00 0.00 0.00 0.00 2.36 1.99 0.00 215 K 9.01 4.18 0.00 1.72 1.84 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.37 1.32 7.81 216 A 8.42 4.06 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 A 8.16 3.84 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 A 7.72 3.83 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 A 8.14 3.73 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 L 8.39 3.60 0.00 1.73 1.62 0.83 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 221 V 7.76 3.57 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.91 0.00 0.00 222 D 8.48 4.25 0.00 2.67 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 A 7.97 4.01 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 A 7.71 3.90 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 K 8.13 4.23 0.00 1.93 1.85 0.00 1.78 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.32 7.81 226 T 7.88 4.01 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 *227 H 7.82 4.49 0.00 3.02 2.97 0.00 7.20 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 G 6.18 4.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 G 8.04 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 R 7.79 3.83 0.00 1.94 2.05 0.00 3.15 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 231 D 7.57 4.98 0.00 2.58 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 N 8.78 4.94 0.00 2.82 2.84 0.00 0.00 7.15 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 V 8.52 4.72 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.93 0.00 0.00 234 T 8.64 5.12 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 235 V 9.04 4.88 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.87 0.00 0.00 236 V 8.63 4.48 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.66 0.00 0.00 237 V 9.08 4.75 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.94 0.00 0.00 238 I 8.78 4.71 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.86 0.91 0.00 0.00 239 S 9.47 4.83 0.00 3.85 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 240 V 8.34 4.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.93 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.